BDBM50245385 3-(4-(2,6-dichlorophenyl)-9-hydroxy-1,3-dioxo-2,3-dihydropyrrolo[3,4-c]carbazol-6(1H)-yl)propanoic acid::CHEMBL460939

SMILES: OC(=O)CCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1c(Cl)cccc1Cl

InChI Key: InChIKey=JMBMSWDEPYGPCH-UHFFFAOYSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50245385   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Serine/threonine-protein kinase Chk1 (Homo sapiens (Human))	BDBM50245385 (3-(4-(2,6-dichlorophenyl)-9-hydroxy-1,3-dioxo-2,3-...) Show SMILES OC(=O)CCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1c(Cl)cccc1Cl |(7.04,-32.43,;8.06,-31.27,;9.57,-31.59,;7.57,-29.81,;8.59,-28.66,;8.11,-27.2,;6.63,-26.73,;5.29,-27.5,;3.95,-26.73,;3.96,-25.18,;2.62,-24.41,;5.29,-24.41,;6.62,-25.18,;8.09,-24.69,;8.71,-23.28,;8.07,-21.88,;6.57,-21.57,;9.21,-20.84,;10.55,-21.6,;11.95,-20.97,;10.24,-23.11,;11.16,-24.35,;10.54,-25.77,;9.01,-25.94,;12.69,-24.18,;13.61,-25.42,;12.99,-26.83,;15.13,-25.24,;15.75,-23.83,;14.82,-22.59,;13.3,-22.77,;13.28,-21.23,)| Show InChI InChI=1S/C23H14Cl2N2O5/c24-13-2-1-3-14(25)18(13)12-9-16-19(21-20(12)22(31)26-23(21)32)11-8-10(28)4-5-15(11)27(16)7-6-17(29)30/h1-5,8-9,28H,6-7H2,(H,29,30)(H,26,31,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Auckland Curated by ChEMBL					Assay Description Inhibition of Chk1 kinase assessed as GST-Cdc25 phosphorylation by Western blot determination				Eur J Med Chem 43: 1276-96 (2008) Article DOI: 10.1016/j.ejmech.2007.07.016 BindingDB Entry DOI: 10.7270/Q26M36MC
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase WEE1 (Homo sapiens (Human))	BDBM50245385 (3-(4-(2,6-dichlorophenyl)-9-hydroxy-1,3-dioxo-2,3-...) Show SMILES OC(=O)CCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1c(Cl)cccc1Cl |(7.04,-32.43,;8.06,-31.27,;9.57,-31.59,;7.57,-29.81,;8.59,-28.66,;8.11,-27.2,;6.63,-26.73,;5.29,-27.5,;3.95,-26.73,;3.96,-25.18,;2.62,-24.41,;5.29,-24.41,;6.62,-25.18,;8.09,-24.69,;8.71,-23.28,;8.07,-21.88,;6.57,-21.57,;9.21,-20.84,;10.55,-21.6,;11.95,-20.97,;10.24,-23.11,;11.16,-24.35,;10.54,-25.77,;9.01,-25.94,;12.69,-24.18,;13.61,-25.42,;12.99,-26.83,;15.13,-25.24,;15.75,-23.83,;14.82,-22.59,;13.3,-22.77,;13.28,-21.23,)| Show InChI InChI=1S/C23H14Cl2N2O5/c24-13-2-1-3-14(25)18(13)12-9-16-19(21-20(12)22(31)26-23(21)32)11-8-10(28)4-5-15(11)27(16)7-6-17(29)30/h1-5,8-9,28H,6-7H2,(H,29,30)(H,26,31,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	390	n/a	n/a	n/a	n/a	n/a	n/a
Chulalongkorn University Curated by ChEMBL					Assay Description Inhibition of human Wee1				Eur J Med Chem 44: 1383-95 (2009) Article DOI: 10.1016/j.ejmech.2008.09.027 BindingDB Entry DOI: 10.7270/Q2X34XB6
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase WEE1 (Homo sapiens (Human))	BDBM50245385 (3-(4-(2,6-dichlorophenyl)-9-hydroxy-1,3-dioxo-2,3-...) Show SMILES OC(=O)CCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1c(Cl)cccc1Cl |(7.04,-32.43,;8.06,-31.27,;9.57,-31.59,;7.57,-29.81,;8.59,-28.66,;8.11,-27.2,;6.63,-26.73,;5.29,-27.5,;3.95,-26.73,;3.96,-25.18,;2.62,-24.41,;5.29,-24.41,;6.62,-25.18,;8.09,-24.69,;8.71,-23.28,;8.07,-21.88,;6.57,-21.57,;9.21,-20.84,;10.55,-21.6,;11.95,-20.97,;10.24,-23.11,;11.16,-24.35,;10.54,-25.77,;9.01,-25.94,;12.69,-24.18,;13.61,-25.42,;12.99,-26.83,;15.13,-25.24,;15.75,-23.83,;14.82,-22.59,;13.3,-22.77,;13.28,-21.23,)| Show InChI InChI=1S/C23H14Cl2N2O5/c24-13-2-1-3-14(25)18(13)12-9-16-19(21-20(12)22(31)26-23(21)32)11-8-10(28)4-5-15(11)27(16)7-6-17(29)30/h1-5,8-9,28H,6-7H2,(H,29,30)(H,26,31,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	390	n/a	n/a	n/a	n/a	n/a	n/a
University of Auckland Curated by ChEMBL					Assay Description Inhibition of human Wee1 assessed as polyornithine-tyrosine copolymer phosphorylation				Eur J Med Chem 43: 1276-96 (2008) Article DOI: 10.1016/j.ejmech.2007.07.016 BindingDB Entry DOI: 10.7270/Q26M36MC
					More data for this Ligand-Target Pair